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Docking Subject

Some aspects, such as the computer representation and manipulation of proteins and nucleic acids, could not be covered. Even the modeling of the interactions of small molecules with proteins, as dealt with in docking software or software for de novo design could not be included in the Textbook, although chapters in the Handbook do treat these subjects. [Pg.12]

There are two predominant problems. First, there is the necessity to keep the plant in operation, which may vary from a non-essential service such as the comfort cooling of an infrequently used room, to the precise temperature control of an expensive or potentially dangerous process. The second problem is the time taken in transit, which might be as long as a year in parts of the world subject to excessive docks and custom delays. [Pg.346]

Transporters may store universal waste for up to 10 days at a transfer facility during the course of transportation. Transfer facilities are transportation-related facilities such as loading docks, parking areas, and storage areas. If a transporter keeps universal waste for more than 10 days at one location, the transporter is subject to all applicable SQHUW or LQHUW regulations. [Pg.446]

Structure file (in SDF format) of the virtual library compounds to be subjected to fixed anchor or partially fixed docking... [Pg.196]

Further, there does not exist sufficient data regarding the biological activity for each enantiomer in a racemic mixture of artemisinin analogues. To help define the antimalarial contribution made by each enantiomer, a model was developed in which 40 racemates were placed as single (+)-enantiomers in the original database of 202 compounds. By doing this it was implied that the (-)-enantiomers are as active as their counterpart, and an optically pure compound is not necessary for antimalarial activity. These achiral models have been discussed as 199 (2 A/C.3) and 199 Dock. A database without the racemates, or chiral models 160 (2 A/C.3) and 160 Dock, were also included in our study. Finally, adjustment to an achiral model was attempted in which the activities of the racemates in the 199 (2 A/C.3) model were multiplied by 2, or model 199 (2 A/C.3). In each case, data was subjected to the statistical pis analysis (Table 18). Relative antimalarial activities were predicted for two racemic compounds 421 and 422,155 using these datasets as shown in Tables 19 and 20. [Pg.209]

During operational life these submarines are subject to periodic maintenance operations which can include refuelling. To undertake these operations, the submarine is taken into dry dock and supported on cradles which provide seismic stability. In addition to the dock gates further protection against flooding is provided by concrete caissons. Before any refuelling operations take place, the primary circuit is decontaminated and... [Pg.61]


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See also in sourсe #XX -- [ Pg.193 ]




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